SCHEMBL20005057

SCHEMBL20005057

Fc1cccc2[nH]c(I)cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.53
DDO Q99489 1/20 0.53
FLT3 P36888 2/20 0.42
HRH4 Q9H3N8 2/20 0.41
ALB P02768 5/20 0.39
IL2 P60568 5/20 0.39
PDE7A Q13946 1/20 0.38
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 1/20 0.37
TNF P01375 1/20 0.36
ALDH1A1 P00352 2/20 0.36
GPR3 P46089 1/20 0.36
HSD17B10 Q99714 1/20 0.36
AHR P35869 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4670793 0.78 DAO (0.56) DAODDOFLT3HRH4ALB
SCHEMBL12778107 0.75 IMPDH2 (0.47) DAODDOHRH4MAPTALDH1A1
SCHEMBL21356683 0.75 AHR (0.45) FLT3HRH4SMN1; SMN2LMNAALDH1A1
SCHEMBL31070422 0.75 AHR (0.45) FLT3HRH4SMN1; SMN2LMNAALDH1A1
SCHEMBL15951255 0.75 DAO (0.53) DAODDOFLT3HRH4ALB
SCHEMBL25142137 0.75 DAO (0.53) DAODDOFLT3HRH4ALB
SCHEMBL12777898 0.75 ALDH1A1 (0.42) HRH4KMT2ANPC1LMNARAB9A
SCHEMBL12777913 0.75 ALDH1A1 (0.36) DAODDOSMN1; SMN2LMNAALDH1A1
SCHEMBL28813362 0.75 DAO (0.53) DAODDOFLT3HRH4ALB
SCHEMBL30605955 0.75 DAO (0.53) DAODDOFLT3HRH4MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114835625-A Synthesis method of axial chiral indole derivative containing 2-thiocyano-3-aryl 泽升科技(广州)有限公司 2022-08-02 CN disclosed
WO-2018055316-A1 COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-03-29 WO disclosed
CN-102256983-B Spirooxindole compounds and their use as therapeutic agents 泽农医药公司 2017-04-05 CN disclosed
CN-105218565-A Spiral shell oxindole compounds and the purposes as therapeutical agent thereof XENON PHARMACEUTICALS INC 2016-01-06 CN disclosed
CN-105175433-A Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2015-12-23 CN disclosed
CN-103664973-A Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2014-03-26 CN disclosed